1-[[4-(1H-isothiochromen-1-ylcarbonylamino)phenyl]amino]ethylidene-dimethyl-azanium

Systemtic Name: 1-[[4-(1H-isothiochromen-1-ylcarbonylamino)phenyl]amino]ethylidene-dimethyl-azanium Openeye Name: 1-[4-(1H-isothiochromene-1-carbonylamino)anilino]ethylidene-dimethyl-ammonium CAS Name: 1-[4-[[1H-2-benzothiopyran-1-yl(oxo)methyl]amino]anilino]ethylidene-dimethylammonium IUPAC Name: 1-[4-(1H-isothiochromene-1-carbonylamino)anilino]ethylidene-dimethylazanium Traditional Name: 1-[4-(1H-isothiochromene-1-carbonylamino)anilino]ethylidene-dimethyl-ammonium Formula: C20H22N3OS+ MolecularWeight: 352.47318

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Descriptors Computed from Structure

Canonical SMILES:

CC(=[N+](C)C)NC1=CC=C(C=C1)NC(=O)C2C3=CC=CC=C3C=CS2

Isomeric SMILES

CC(=[N+](C)C)NC1=CC=C(C=C1)NC(=O)C2C3=CC=CC=C3C=CS2

InChI

InChI=1S/C20H21N3OS/c1-14(23(2)3)21-16-8-10-17(11-9-16)22-20(24)19-18-7-5-4-6-15(18)12-13-25-19/h4-13,19H,1-3H3,(H,22,24)/p+1